2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide

C11H23N3O — CID 82013214

IUPAC2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)C1CNC(C)(C)C1
InChIInChI=1S/C11H23N3O/c1-8(2)14(7-10(12)15)9-5-11(3,4)13-6-9/h8-9,13H,5-7H2,1-4H3,(H2,12,15)
InChIKeyLXYNMRASJGCWPJ-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.32
Rot. Bonds4

About 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide

2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide (PubChem CID 82013214) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide
PubChem CID82013214
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)C1CNC(C)(C)C1
InChIInChI=1S/C11H23N3O/c1-8(2)14(7-10(12)15)9-5-11(3,4)13-6-9/h8-9,13H,5-7H2,1-4H3,(H2,12,15)
InChIKeyLXYNMRASJGCWPJ-UHFFFAOYSA-N
XLogP0.32
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide?
The IUPAC name of 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide (CID 82013214) is 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide is CC(C)N(CC(N)=O)C1CNC(C)(C)C1.
What is the InChIKey of 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide?
The InChIKey is LXYNMRASJGCWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-8(2)14(7-10(12)15)9-5-11(3,4)13-6-9/h8-9,13H,5-7H2,1-4H3,(H2,12,15).
What are the key properties of 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide?
2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide has a molecular weight of 213.32 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5,5-dimethylpyrrolidin-3-yl)-propan-2-ylamino]acetamide is sourced from PubChem (CID 82013214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).